1-[4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]propan-1-one

Systemtic Name: 1-[4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]propan-1-one CAS Name: 1-[4-[4-nitro-3-(phenethylamino)phenyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]propan-1-one Traditional Name: 1-[4-[4-nitro-3-(phenethylamino)phenyl]piperazino]propan-1-one Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCCC3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCCC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3/c1-2-21(26)24-14-12-23(13-15-24)18-8-9-20(25(27)28)19(16-18)22-11-10-17-6-4-3-5-7-17/h3-9,16,22H,2,10-15H2,1H3